ethyl 2-[(3S,4S)-7,7-dimethyl-3-oxidanyl-4-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]propanoate

Systemtic Name: ethyl 2-[(3S,4S)-7,7-dimethyl-3-oxidanyl-4-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]propanoate Openeye Name: ethyl 2-[(1S,2S)-2-hydroxy-7,7-dimethyl-1-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)norbornan-2-yl]propanoate CAS Name: 2-[(3S,4S)-3-hydroxy-7,7-dimethyl-4-(1'-spiro[indene-1,4'-piperidine]ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(3S,4S)-3-hydroxy-7,7-dimethyl-4-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]propanoate Traditional Name: 2-[(1S,2S)-2-hydroxy-7,7-dimethyl-1-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)norbornan-2-yl]propionic acid ethyl ester Formula: C28H39NO5S MolecularWeight: 501.67796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1(CC2CCC1(C2(C)C)CS(=O)(=O)N3CCC4(CC3)C=CC5=CC=CC=C45)O

Isomeric SMILES

CCOC(=O)C(C)[C@]1(CC2CC[C@@]1(C2(C)C)CS(=O)(=O)N3CCC4(CC3)C=CC5=CC=CC=C45)O

InChI

InChI=1S/C28H39NO5S/c1-5-34-24(30)20(2)28(31)18-22-11-13-27(28,25(22,3)4)19-35(32,33)29-16-14-26(15-17-29)12-10-21-8-6-7-9-23(21)26/h6-10,12,20,22,31H,5,11,13-19H2,1-4H3/t20?,22?,27-,28-/m0/s1